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1807036-97-0 | 3-Pyridinemethanol, 4-bromo-6-chloro-
CAS No: 1807036-97-0 Catalog No: AG002294 MDL No:
Product Description
Catalog Number:
AG002294
Chemical Name:
3-Pyridinemethanol, 4-bromo-6-chloro-
CAS Number:
1807036-97-0
Molecular Formula:
C6H5BrClNO
Molecular Weight:
222.4670
IUPAC Name:
(4-bromo-6-chloropyridin-3-yl)methanol
InChI:
InChI=1S/C6H5BrClNO/c7-5-1-6(8)9-2-4(5)3-10/h1-2,10H,3H2
InChI Key:
LSANKXPSPPPENY-UHFFFAOYSA-N
SMILES:
OCc1cnc(cc1Br)Cl
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.924g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.466g/mol
Monoisotopic Mass:
220.924g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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